(4E)-4-(cyanomethylidene)-N-(naphthalen-1-ylmethyl)-1-(phenylcarbonyl)pyrrolidine-2-carboxamide

Systemtic Name: (4E)-4-(cyanomethylidene)-N-(naphthalen-1-ylmethyl)-1-(phenylcarbonyl)pyrrolidine-2-carboxamide Openeye Name: (4E)-1-benzoyl-4-(cyanomethylene)-N-(1-naphthylmethyl)pyrrolidine-2-carboxamide CAS Name: (4E)-1-benzoyl-4-(cyanomethylidene)-N-(1-naphthalenylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (4E)-1-benzoyl-4-(cyanomethylidene)-N-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (4E)-1-benzoyl-4-(cyanomethylene)-N-(1-naphthylmethyl)pyrrolidine-2-carboxamide Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC1=CC#N)C(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C\1C(N(C/C1=C/C#N)C(=O)C2=CC=CC=C2)C(=O)NCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H21N3O2/c26-14-13-18-15-23(28(17-18)25(30)20-8-2-1-3-9-20)24(29)27-16-21-11-6-10-19-7-4-5-12-22(19)21/h1-13,23H,15-17H2,(H,27,29)/b18-13+